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Substance Name: Hebevinoside V
RN: 101365-07-5
InChIKey: AMBFYXVSRGPNHQ-XELSLTKESA-N

Molecular Formula

  • C46-H74-O14

Molecular Weight

  • 851.077
 
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Names and Synonyms

  • Hebevinoside V

Registry Numbers

CAS Registry Number

  • 101365-07-5

System Generated Number

  • 0101365075

Structure Descriptors

InChI

1S/C46H74O14/c1-23(2)13-12-14-24(3)34-30(58-42-39(53)37(51)35(49)32(59-42)21-55-25(4)47)20-46(10)40-29(54-11)19-28-27(44(40,8)17-18-45(34,46)9)15-16-33(43(28,6)7)60-41-38(52)36(50)31(22-56-41)57-26(5)48/h13,19,24,27,29-42,49-53H,12,14-18,20-22H2,1-11H3/t24-,27+,29-,30-,31-,32-,33?,34+,35-,36+,37+,38-,39-,40?,41+,42-,44-,45-,46+/m1/s1

InChIKey

AMBFYXVSRGPNHQ-XELSLTKESA-N

Smiles

O([C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)COC(C)=O)[C@@H]1C[C@@]2([C@@H]3[C@@H](C=C4C([C@@H](CC[C@H]4[C@@]3(CC[C@@]2([C@H]1[C@@H](CC\C=C(\C)C)C)C)C)O[C@H]1[C@H](O)[C@@H](O)[C@H](OC(=O)C)CO1)(C)C)OC)C