Metabolites-BOC Sciences

4-Hydroxybaumycinol A2

4-Hydroxybaumycinol A2 - CAS 78962-31-9

Catalog number: BBF-00991

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Catalog Number BBF-00991
CAS 78962-31-9
Description 4-Hydroxybaumycinol A2 is an anthracycline antibiotic produced by Actinomadura sp. D326. It has anti-tumor activity.
Molecular Formula C33H43NO13
Molecular Weight 661.70
Antibiotic Activity Spectrum neoplastics (Tumor)
Synonyms Rubeomycin B1
IUPAC Name (9S)-7-[(4S,5S,6S)-4-amino-5-[(1R,3S)-3-hydroxy-1-[(2S)-1-hydroxypropan-2-yl]oxybutoxy]-6-methyloxan-2-yl]oxy-4,6,9,11-tetrahydroxy-9-[(1R)-1-hydroxyethyl]-8,10-dihydro-7H-tetracene-5,12-dione
Canonical SMILES CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)O)O)(C(C)O)O)N)OC(CC(C)O)OC(C)CO
InChI InChI=1S/C33H43NO13/c1-13(36)8-22(44-14(2)12-35)47-32-15(3)45-23(9-19(32)34)46-21-11-33(43,16(4)37)10-18-25(21)31(42)27-26(29(18)40)28(39)17-6-5-7-20(38)24(17)30(27)41/h5-7,13-16,19,21-23,32,35-38,40,42-43H,8-12,34H2,1-4H3/t13-,14-,15-,16+,19-,21?,22+,23?,32+,33-/m0/s1
InChI Key QSLSPJFMOXHLJX-VDTLOKLVSA-N
Boiling Point 882.3±65.0 °C at 760 mmHg
Melting Point 149-153°C
Density 1.5±0.1 g/cm3
Appearance Dark Red Powder
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