ID: 32299
SMILES:C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.425
InChIKey:VETSYTHGICVFOX-UHFFFAOYSA-N
ID: 32300
SMILES:C1C2=C(c3c(cc(CCCCC)c(C(=O)O)c3O)OC2C=C(C)C)C(=O)C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.499
CB1 binding score: -16.502
InChIKey:BYHPAHUERIDEQZ-UHFFFAOYSA-N
ID: 32301
SMILES:C(c1cc(O)c(CC=C(CCC=C(CCC=C(C)C)C)C)c(O)c1)SC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 374.59
CB1 binding score: -12.77
InChIKey:GMBGWBBEUVZXDC-UHFFFAOYSA-N
ID: 32302
SMILES:O(c1c(C2C(C(C)C)CCC(C)=C2)c(OC)cc2c1OC(=O)c1c(O)cc(CCCCC)cc1OC2CO)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 538.681
CB1 binding score: -13.411
InChIKey:UCKSJZAFVLBYKM-UHFFFAOYSA-N
ID: 32303
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 32304
SMILES:C1(C)=CC(CC(=CCc2cc(O)cc(C)c2O)C)C2(CC1)OC(=O)C(C)=C2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.472
CB1 binding score: -17.341
InChIKey:MVBKDWPOTLLKKS-UHFFFAOYSA-N
ID: 32305
SMILES:C(CO)c1cc(O)c(C2C=C(C)CCC2C(=CCC=C(C)C)C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -13.817
InChIKey:MHVCLAJBHHBDRV-UHFFFAOYSA-N
ID: 32306
SMILES:C1(C)(C)OC2(C)C3C(C2)Oc2c(cc(CCCCC)cc2O)C3C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.929
InChIKey:UTPIAZGGNFRVNH-UHFFFAOYSA-N
ID: 32307
SMILES:C12(C)C(c3c(O)cc(CCCCC)cc3O1)CC(C(C)C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.279
InChIKey:NSKWGYBRKCMGQG-UHFFFAOYSA-N
ID: 32308
SMILES:C1=CC(C)=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.425
InChIKey:OREKNOSHKYJKSL-UHFFFAOYSA-N
ID: 32309
SMILES:C=C(C1C2(OC)C=C(OC)C(O)=C(CC=C(C)C)C2(O)Oc2cc(CCCCC)cc(O)c21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.606
CB1 binding score: -13.663
InChIKey:YTQFCBAGAPGRNU-UHFFFAOYSA-N
ID: 32310
SMILES:O(c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21)CCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.515
InChIKey:WZVHVTCOFLKDSB-UHFFFAOYSA-N
ID: 32311
SMILES:c1(O)c(OC)c(CCc2ccccc2)cc(O)c1CC1C(C)(C)OC(C)(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -7.502
InChIKey:XHSDMYIBNSICCB-UHFFFAOYSA-N
ID: 32312
SMILES:CC1=CC2c3c(O)cc(C)cc3OC(C)(C)C2CC1Cl
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.806
CB1 binding score: -17.123
InChIKey:NJPHDCINWNOAHI-UHFFFAOYSA-N
ID: 32313
SMILES:C1CC(C)(Cc2c(O)cc(CCCC)cc2O)OC1C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.565
CB1 binding score: -16.717
InChIKey:MRWMSFKVZJEOLS-UHFFFAOYSA-N
ID: 32314
SMILES:C(C1CCC(C)C(=O)C1c1c(O)cc(CCC)cc1O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.495
InChIKey:JGFDNLDQSRHHSY-UHFFFAOYSA-N
ID: 32315
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(O)(COC(=O)C)CC21)=CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -14.218
InChIKey:ORCGHNVSJUABAB-UHFFFAOYSA-N
ID: 32316
SMILES:c1(OC2C(O)C(O)C(O)C(CO)O2)cc(CCC)cc2c1C1C3C(C)(CCC3C(=C)C)OC(=O)C(C)=C1CC1(O)C(C)(C=CC(=O)C1=C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 680.791
CB1 binding score: -13.191
InChIKey:GLKIRRVEILDTDL-UHFFFAOYSA-N
ID: 32317
SMILES:C1C(O)(C)C(OC2OC(CO)C(O)C(O)C2O)C2C1C(C)(C)Oc1cc(CCCCC)c(C(=O)O)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 540.606
CB1 binding score: -12.362
InChIKey:JBWXGUNKOYXSHX-UHFFFAOYSA-N
ID: 32318
SMILES:C(C1=CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2CC1)(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.63
InChIKey:XKJHMRMUZXJASC-UHFFFAOYSA-N
ID: 32319
SMILES:C1(=C)CCC(C(C)(CCC=C(C)CCC=C(C)C)O)Oc2cc(CCCCC)cc(O)c21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.668
CB1 binding score: -14.133
InChIKey:QGKKMFSSFUTZRR-UHFFFAOYSA-N