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Substance Name: Coagulin H
RN: 216163-59-6
UNII: 2XL927E74R
InChIKey: ALRJHGQYWPZYNC-ALBMBVGKSA-N

Molecular Formula

  • C28-H40-O9

Molecular Weight

  • 520.615
 
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Names and Synonyms

Name of Substance

  • Coagulin H

Synonyms

  • Coagulin H
  • Ergosta-2,24-dien-26-oic acid, 5,6,14,15,17,20,22-heptahydroxy-1-oxo-, delta-lactone, (5alpha,6beta,15alpha,17alpha,22R)-
  • UNII-2XL927E74R

Registry Numbers

CAS Registry Number

  • 216163-59-6

FDA UNII

  • 2XL927E74R

System Generated Number

  • 0216163596

Structure Descriptors

InChI

1S/C28H40O9/c1-14-11-21(37-22(32)15(14)2)25(5,33)27(35)13-20(31)28(36)17-12-19(30)26(34)9-6-7-18(29)24(26,4)16(17)8-10-23(27,28)3/h6-7,16-17,19-21,30-31,33-36H,8-13H2,1-5H3/t16-,17+,19+,20-,21+,23+,24-,25-,26-,27-,28-/m0/s1

InChIKey

ALRJHGQYWPZYNC-ALBMBVGKSA-N

Smiles

CC1=C(C(=O)O[C@H](C1)[C@@](C)([C@@]2(C[C@@H]([C@@]3([C@@]2(CC[C@H]4[C@H]3C[C@H]([C@@]5([C@@]4(C(=O)C=CC5)C)O)O)C)O)O)O)O)C