ID: 112393
SMILES:CC1(C)C2CC(=O)C(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 112394
SMILES:c1(O)c(OC)cc2c(c1)C1C(C(C)(C)O2)CCC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.94
InChIKey:VTBFJUFJPUTQBN-UHFFFAOYSA-N
ID: 112395
SMILES:OC(CCc1cc(O)c(C2C(C(O)(C)C)CCC(C)=C2)c(O)c1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: -16.53
InChIKey:MOCPRZYVCFFJNO-UHFFFAOYSA-N
ID: 112396
SMILES:C1C2(C)Oc3c(c(O)cc(C)c3)C(C2)C(C(=C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.387
InChIKey:VVRJCBBASZRUGL-UHFFFAOYSA-N
ID: 112397
SMILES:O=C(C12C(=O)C(C)C(=O)C(C)(C)C1O)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.514
CB1 binding score: -13.77
InChIKey:SEJCWLKONPYPAW-UHFFFAOYSA-N
ID: 112398
SMILES:C1(C)=CCC2C1c1c(cc(CCCCC)cc1O)OC(C)(C)C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.929
InChIKey:HUQDUERNOOYMMI-UHFFFAOYSA-N
ID: 112399
SMILES:C(CCC)Cc1c(O)c2c(c(O)c1)C1C=C(C)CCC1C(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.234
InChIKey:UBQQIHUSDBJPBP-UHFFFAOYSA-N
ID: 112400
SMILES:CC1(C)Oc2c(c(O)cc(O)c2C(C(C)C(O)=O)=O)CC2C1CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.422
CB1 binding score: -13.322
InChIKey:OMXFZFMEZOFJJE-UHFFFAOYSA-N
ID: 112401
SMILES:c12c(cc(C)cc1O)OC(CCC1(C)C3C=C(C(C)(OC)C)C(CCCC)OC3=O)(C)C1CCC2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.676
CB1 binding score: -15.373
InChIKey:ZVFDPFVZIFWLJH-UHFFFAOYSA-N
ID: 112402
SMILES:C1(O)C(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 112403
SMILES:CC1=CC2C(C1)C(C)(C)Oc1c2cc(O)c(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 244.334
CB1 binding score: -16.767
InChIKey:ZQEYFSGPWCAWNS-UHFFFAOYSA-N
ID: 112404
SMILES:C=C(C)C(CCC(=CCc1c(O)cc(CCCCC)cc1OC)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.667
InChIKey:DKPAZXCFVUXZQG-UHFFFAOYSA-N
ID: 112405
SMILES:C(C)CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 112406
SMILES:Oc1cc(CO)c2c(c1CCCCC)OC(C)(CCC=C(CCC=C(C)C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -15.776
InChIKey:XMMKSBSHAFPMPV-UHFFFAOYSA-N
ID: 112407
SMILES:Oc1c(CC=C(C)C)cc2c(c1)OC(C)(C)C1CCC(C(=O)O)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -13.306
InChIKey:GTRXJGZYGBHSKF-UHFFFAOYSA-N
ID: 112408
SMILES:C1CC2C(C)(C)Oc3c(CCC(=O)C)c(C)cc(O)c3C2C=C1CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.741
InChIKey:HRRGTCMPVAJQIB-UHFFFAOYSA-N
ID: 112409
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 112410
SMILES:CCCCCc1cc2c(c(OC)c1)C1C(=C(C)C)CCC(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.524
CB1 binding score: -14.449
InChIKey:JEGXBZVFNUORGW-UHFFFAOYSA-N
ID: 112411
SMILES:C1C(C)=CCC(C)(C)C1CC(=O)C(C)=CCc1cc(O)cc(C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.293
InChIKey:BNABHCJJSORWKJ-UHFFFAOYSA-N
ID: 112412
SMILES:c1c(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c(C=O)c1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -17.241
InChIKey:ZRENVVUZARSAET-UHFFFAOYSA-N
ID: 112413
SMILES:c1(C)c(C2C(CC(C)C)=CC(=C)CC2)c(O)cc(CCCCC)n1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 327.512
CB1 binding score: -13.825
InChIKey:LTPFCTGIQUGRLB-UHFFFAOYSA-N