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Substance Name: Macrocalin A
RN: 10391-08-9
InChIKey: QOAOBBJDPFYUKJ-RVMSTXCCSA-N

Note

  • From leaves of Rabdosia macrocalyx; has cytotoxicity in vitro against cultures of Hela cells.

Molecular Weight

  • 346.4204
 
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Names and Synonyms

Name of Substance

  • Macrocalin A

Systematic Name

  • Enmein, 13-deoxy-

Registry Numbers

CAS Registry Number

  • 10391-08-9

System Generated Number

  • 0010391089

Structure Descriptors

InChI

1S/C20H26O5/c1-10-11-4-5-12-19(8-11,15(10)21)17(23)25-13-6-7-18(2,3)14-16(22)24-9-20(12,13)14/h11-14,16,22H,1,4-9H2,2-3H3/t11-,12-,13+,14-,16-,19+,20-/m1/s1

InChIKey

QOAOBBJDPFYUKJ-RVMSTXCCSA-N

Smiles

C1(C([C@@]23[C@@H](CC[C@@H]1C2)[C@@]12[C@@H](C(CC[C@@H]2OC3=O)(C)C)[C@@H](OC1)O)=O)=C