Sandramycin
[CAS# 100940-65-6]

Identification

• Name: Sandramycin
• Synonyms: Sandramycin; Aids-107885; Aids107885
• Molecular Formula: C₆₀H₇₆N₁₂O₁₆
• Molecular Weight: 1221.33
• CAS Registry Number: 100940-65-6
• SMILES: [C@H]5(NC(=O)C1=NC2=C(C=C1O)C=CC=C2)C(=O)N7[C@H](C(=O)NCC(=O)N(CC(=O)N([C@H](C(OC[C@@H](NC(=O)C3=NC4=C(C=C3O)C=CC=C4)C(=O)N6[C@H](C(=O)NCC(=O)N(CC(=O)N([C@H](C(OC5)=O)C(C)C)C)C)CCCC6)=O)C(C)C)C)C)CCCC7
• InChI: 1S/C60H76N12O16/c1-33(2)51-59(85)87-31-39(65-55(81)49-43(73)25-35-17-9-11-19-37(35)63-49)57(83)71-23-15-13-21-41(71)53(79)62-28-46(76)68(6)30-48(78)70(8)52(34(3)4)60(86)88-32-40(66-56(82)50-44(74)26-36-18-10-12-20-38(36)64-50)58(84)72-24-16-14-22-42(72)54(80)61-27-45(75)67(5)29-47(77)69(51)7/h9-12,17-20,25-26,33-34,39-42,51-52,73-74H,13-16,21-24,27-32H2,1-8H3,(H,61,80)(H,62,79)(H,65,81)(H,66,82)/t39-,40-,41+,42+,51+,52+/m1/s1
• InChIKey: WXIVYIYCEBUEHL-RTQGILJWSA-N

Properties

• Density: 1.426g/cm³ (Cal.)
• Boiling point: 1518.371°C at 760 mmHg (Cal.)
• Flash point: 872.079°C (Cal.)