ID: 44416
SMILES:C(CCc1cc2c(c(O)c1)C1C(O2)C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -14.224
InChIKey:HOHGMXAYINNEAL-UHFFFAOYSA-N
ID: 44417
SMILES:C(O)(C1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 44418
SMILES:C(=C)(C1CC=C(C)CC1c1c(O)c(O)cc(CCCCC)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.261
InChIKey:GJEOQHWRMBIAAH-UHFFFAOYSA-N
ID: 44419
SMILES:CC(CC)C(=O)c1c(O)c2c(cc1)C1C=C(C)CCC1C(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -15.929
InChIKey:GJODFKRNZNEDPT-UHFFFAOYSA-N
ID: 44420
SMILES:CC1=CC(c2ccc(CCCCC)c(O)c2O)C(C(OC)(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -14.283
InChIKey:KFDBIFCFQSDUDK-UHFFFAOYSA-N
ID: 44421
SMILES:CC(C)CCCc1cc2c(c(O)c1)C1=C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.175
InChIKey:NFWPWCLGONOUBJ-UHFFFAOYSA-N
ID: 44422
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2CC3CCC(C)(OC32C)C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.088
InChIKey:XNAGYUKPJJBBDO-UHFFFAOYSA-N
ID: 44423
SMILES:C(CCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.691
InChIKey:JUCOHRGEXRGBDB-UHFFFAOYSA-N
ID: 44424
SMILES:C12CCC(C)CC1c1c(cc(CCCCCC)c(C(=O)OC)c1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -16.849
InChIKey:LSIMCIOCSQFMSI-UHFFFAOYSA-N
ID: 44425
SMILES:C1(O)CC(C)=CCCC(C)=CC2c3c(O)cc(C)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.802
InChIKey:GUVSTSHTBXLRNX-UHFFFAOYSA-N
ID: 44426
SMILES:C12C3(C)C(=O)C=CC=C3OC(C)(C)C1CC=C2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -16.125
InChIKey:FVCWHEZMHIJDEM-UHFFFAOYSA-N
ID: 44427
SMILES:C1C(C)CCC(C(C)C)C1c1c(O)ccc(CCCCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.502
CB1 binding score: -17.344
InChIKey:VAAFGXFSKSKENC-UHFFFAOYSA-N
ID: 44428
SMILES:c1c(C2C=C(C)CCC2C(=C)C)c(C=CC(=C)C)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 294.438
CB1 binding score: -13.551
InChIKey:NATZUBMEPIQIAH-UHFFFAOYSA-N
ID: 44429
SMILES:C1(CO)=C2C(C3=CC1C(C)(C)OO3)CC(CO)(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 266.337
CB1 binding score: -13.069
InChIKey:VJSGEOOEWCOAEF-UHFFFAOYSA-N
ID: 44430
SMILES:C(C)CCCCc1c(C(OC)=O)c(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -18.387
InChIKey:BNPZQKQNYWPHNN-UHFFFAOYSA-N
ID: 44431
SMILES:c12c3c4c(c(O)c(C)c3ccc1O)OC(C)(C)C1CCC(C)=CC4OC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.43
CB1 binding score: -15.643
InChIKey:KXTVQSILNNWLQZ-UHFFFAOYSA-N
ID: 44432
SMILES:C1Oc2cc(CCCC)cc(O)c2C1C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -16.286
InChIKey:HFKBPIFNVWICBB-UHFFFAOYSA-N
ID: 44433
SMILES:O1c2cc(CCCCC)cc(O)c2C2CC(C)=CC(O)C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.787
InChIKey:FFKCKJVBFXMFGY-UHFFFAOYSA-N
ID: 44434
SMILES:c12cc(CCCCC)cc(O)c1C1C(C(C)(C)O2)CC(CC=C(C)C)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -16.875
InChIKey:CEDPPDATBVHSPZ-UHFFFAOYSA-N
ID: 44435
SMILES:C12C(C)(CCCC1(C)C)Oc1c(c(O)cc(C(C)C(C)C)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.683
InChIKey:KVBBTLGUBBNHLH-UHFFFAOYSA-N
ID: 44436
SMILES:CC1(CCC=C(C)C)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N