Notoginsenoside H

CAS Registry Number®

193976-69-1

CAS Name

Notoginsenoside H

Molecular Formula

C47H80O19

Molecular Mass

949.13

Cite this Page

Notoginsenoside H.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=193976-69-1 (retrieved 2024-12-24) (CAS RN: 193976-69-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C47H80O19/c1-42(2,60)12-9-13-47(8,66-40-36(59)33(56)31(54)25(18-48)63-40)21-10-15-45(6)29(21)22(50)16-27-44(5)14-11-28(52)43(3,4)38(44)24(17-46(27,45)7)62-41-37(34(57)32(55)26(19-49)64-41)65-39-35(58)30(53)23(51)20-61-39/h9,12,21-41,48-60H,10-11,13-20H2,1-8H3/t21-,22+,23+,24-,25+,26+,27+,28-,29-,30-,31+,32+,33-,34-,35+,36+,37+,38-,39-,40-,41+,44+,45+,46+,47-/m0/s1

InChIKey

InChIKey=BIRZHRCAUBJIEK-ILNSJTJMSA-N

SMILES

C[C@]12[C@@]([C@]3(C)[C@@]([C@@H](O[C@H]4[C@H](O[C@H]5[C@H](O)[C@@H](O)[C@H](O)CO5)[C@@H](O)[C@H](O)[C@@H](CO)O4)C1)(C(C)(C)[C@@H](O)CC3)[H])(C[C@@H](O)[C@]6([C@@]2(C)CC[C@@]6([C@@](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)(CC=CC(C)(C)O)C)[H])[H])[H]

Canonical SMILES

OCC1OC(OC(C)(CC=CC(O)(C)C)C2CCC3(C)C2C(O)CC4C5(C)CCC(O)C(C)(C)C5C(OC6OC(CO)C(O)C(O)C6OC7OCC(O)C(O)C7O)CC43C)C(O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranoside, (3β,6α,12β)-20-(β-D-glucopyranosyloxy)-3,12,25-trihydroxydammar-23-en-6-yl 2-O-β-D-xylopyranosyl-
  • (3β,6α,12β)-20-(β-D-Glucopyranosyloxy)-3,12,25-trihydroxydammar-23-en-6-yl 2-O-β-D-xylopyranosyl-β-D-glucopyranoside
  • Notoginsenoside H

Deleted or Replaced CAS Registry Numbers

193980-90-4

CAS INSIGHTSTM
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