Dihydroaeruginoic acid,HPLC>98%结构式,Dihydroaeruginoic acid...

来自 : m.chem960.com/structure/sc1432 发布时间：2021-03-25

9.7843 10.2050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4247 9.4200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0650 10.2050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0650 11.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7053 12.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4247 12.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7843 11.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2800 8.8453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4950 10.2050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7100 11.5647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7100 8.8453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4950 7.4857 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 8.8453 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 7.4857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 7.4857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 8.8453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 10.2050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 10.2050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 6.1260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 4.7664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7100 6.1260 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 26.1002 14.9150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 4 3 1 6 0 0 0 4 5 1 0 0 0 0 5 6 1 6 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 1 0 0 0 11 10 1 1 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 1 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 22 20 1 1 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 6 0 0 0 25 26 1 0 0 0 0 24 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 6 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 6 0 0 0 32 34 1 0 0 0 0 34 35 2 0 0 0 0 35 36 1 0 0 0 0 36 37 2 0 0 0 0 37 38 1 0 0 0 0 38 39 2 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 41 44 1 0 0 0 0 45 44 1 6 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 6 0 0 0 48 50 1 0 0 0 0 50 51 1 0 0 0 0 51 45 1 0 0 0 0 47 52 1 6 0 0 0 47 53 1 0 0 0 0 53 54 2 0 0 0 0 53 55 1 0 0 0 0 55 56 2 0 0 0 0 55 57 1 0 0 0 0 57 58 1 0 0 0 0 58 59 1 0 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 57 1 0 0 0 0 58 63 1 1 0 0 0 63 64 2 0 0 0 0 63 65 1 0 0 0 0 9 66 1 0 0 0 0 66 4 1 0 0 0 0M CHG 1 1 1M CHG 1 65 -1M END

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Dihydroaeruginoic acid,HPLC 98% Smile 编码: [Na+].CO[C@@H]1[C@H](O)CC[C@@H](C[C@@H](C)/C=C/C(=O)[C@H](C)/C=C(C)/[C@@H](O)[C@H](OC)C(=O)[C@H](C)C[C@H](C)/C=C/C=C/C=C(C)/C(OC)C[C@@H]2O[C@@]([C@H](C)CC2)(O)C(=O)C(=O)N3[C@H](CCCC3)C(=O)[O-])C1

Dihydroaeruginoic acid,HPLC 98% InChi 编码: InChI=1S/C51H79NO13.Na/c1-31(26-35(5)45(55)47(64-10)46(56)36(6)28-34(4)41(53)23-19-32(2)27-38-21-24-42(54)44(29-38)63-9)16-12-11-13-17-33(3)43(62-8)30-39-22-20-37(7)51(61,65-39)48(57)49(58)52-25-15-14-18-40(52)50(59)60;/h11-13,16-17,19,23,28,31-32,34-35,37-40,42-44,46-47,54,56,61H,14-15,18,20-22,24-27,29-30H2,1-10H3,(H,59,60);/q;+1/p-1/b13-11+,16-12+,23-19+,33-17+,36-28+;/t31-,32+,34-,35-,37-,38+,39-,40-,42-,43?,44+,46-,47-,51-;/m1./s1

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