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Substance Name: Crassicautine
RN: 109333-61-1
InChIKey: OFXAETWIISXNGM-UHFFFAOYSA-N

Molecular Weight

  • 631.758
 
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Names and Synonyms

  • Crassicautine

Registry Numbers

CAS Registry Number

  • 109333-61-1

System Generated Number

  • 0109333611

Structure Descriptors

InChI

1S/C34H49NO10/c1-8-35-16-31(17-39-2)21(36)13-22(41-4)34-20-14-32(38)23(42-5)15-33(44-7,25(28(34)35)26(43-6)27(31)34)24(20)29(32)45-30(37)18-9-11-19(40-3)12-10-18/h9-12,20-29,36,38H,8,13-17H2,1-7H3

InChIKey

OFXAETWIISXNGM-UHFFFAOYSA-N

Smiles

c1(ccc(C(O[C@@H]2[C@@H]3[C@@H]4[C@@]56[C@@H]7[C@@H]([C@@]3(OC)C[C@@H](OC)[C@@]2(C4)O)[C@@H]([C@@H]5[C@@](C[N@@]7CC)(COC)[C@@H](C[C@@H]6OC)O)OC)=O)cc1)OC