Ziziphin

CAS Registry Number®

73667-51-3
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CAS Name

Ziziphin

Molecular Formula

C51H80O18

Molecular Mass

981.17

Cite this Page

Ziziphin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=73667-51-3 (retrieved 2024-04-19) (CAS RN: 73667-51-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C51H80O18/c1-23(2)18-28-19-49(11,69-45-41(65-27(6)53)40(64-26(5)52)35(55)25(4)63-45)42-29-12-13-32-47(9)16-15-33(46(7,8)31(47)14-17-48(32,10)50(29)21-51(42,68-28)61-22-50)67-43-38(58)36(56)30(20-60-43)66-44-39(59)37(57)34(54)24(3)62-44/h18,24-25,28-45,54-59H,12-17,19-22H2,1-11H3

InChIKey

InChIKey=SPFBVQWRJFUDBB-UHFFFAOYSA-N

SMILES

CC12C34C(C5C(C3)(OC4)OC(C=C(C)C)CC5(OC6C(OC(C)=O)C(OC(C)=O)C(O)C(C)O6)C)CCC1C7(C)C(CC2)C(C)(C)C(OC8C(O)C(O)C(OC9C(O)C(O)C(O)C(C)O9)CO8)CC7

Canonical SMILES

O=C(OC1C(OC(C)C(O)C1OC(=O)C)OC2(C)CC(OC34OCC5(C3)C(CCC6C7(C)CCC(OC8OCC(OC9OC(C)C(O)C(O)C9O)C(O)C8O)C(C)(C)C7CCC65C)C42)C=C(C)C)C

Other Names for this Substance

  • α-L-Mannopyranoside, (3β,16β,23R)-3-[[4-O-(6-deoxy-α-L-mannopyranosyl)-α-L-arabinopyranosyl]oxy]-16,23:16,30-diepoxydammar-24-en-20-yl 6-deoxy-, 2,3-diacetate
  • Ziziphin

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