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Substance Name: Anthrotainin
RN: 148084-40-6
InChIKey: HWLAJZAXDIBLQS-UXHICEINSA-N

Note

  • Isolated from Gliocladium catenulatum; substance P antagonist.

Molecular Weight

  • 415.3523
 
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Names and Synonyms

Name of Substance

  • Anthrotainin

Systematic Name

  • 2-Naphthacenecarboxamide, 3,4,4a,5,12,12a-hexahydro-1,4a,10,11,12a-pentahydroxy-8-methoxy-3,12-dioxo-, (cis)-

Registry Numbers

CAS Registry Number

  • 148084-40-6

System Generated Number

  • 0148084406

Structure Descriptors

InChI

1S/C20H17NO9/c1-30-9-3-7-2-8-5-19(28)6-11(23)14(18(21)27)17(26)20(19,29)16(25)13(8)15(24)12(7)10(22)4-9/h2-4,22,24,26,28-29H,5-6H2,1H3,(H2,21,27)/t19-,20+/m1/s1

InChIKey

HWLAJZAXDIBLQS-UXHICEINSA-N

Smiles

COc1cc2cc3c(c(c2c(c1)O)O)C(=O)[C@@]4(C(=C(C(=O)C[C@@]4(C3)O)C(=O)N)O)O