ID: 56995
SMILES:c1(O)cc(C)cc2c1C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.328
InChIKey:IWHYDYORMMBLMI-UHFFFAOYSA-N
ID: 56996
SMILES:C12C(C)(CC(OC3C(O)C(O)C(O)C(CO)O3)C=C(C)C)Oc3c(c(OC)cc(CCCCC)c3)C1OC(=O)C(=C)C2CCC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 660.801
CB1 binding score: -15.467
InChIKey:VXQOMSGHDQLEME-UHFFFAOYSA-N
ID: 56997
SMILES:c1cc(CCC(C2CCC(C)=CC2c2cc(O)c(CC=C(C)CCC=C(C)C)c(O)c2)CO)ccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.711
CB1 binding score: -13.473
InChIKey:BEIJGMKRTCQFSC-UHFFFAOYSA-N
ID: 56998
SMILES:c1(CCC)cc(C2C=C(C)CCC2C(=C)C)c(O)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.644
InChIKey:IPOIDPVXKKNDPY-UHFFFAOYSA-N
ID: 56999
SMILES:C(CCC(=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)C)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 57000
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.949
InChIKey:QNRSRQLQOLFRRN-UHFFFAOYSA-N
ID: 57001
SMILES:C(CCC)Cc1c(C(=O)O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 57002
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c3)C3C2C(C(C(C)C)C1)CC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -15.05
InChIKey:KPOPWSUGXSKTAV-UHFFFAOYSA-N
ID: 57003
SMILES:CC(C)=CC1c2c(cc(CC(C)C)c(O)c2O)OC(C)(C)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.27
InChIKey:DYPNTJFIIRBFLU-UHFFFAOYSA-N
ID: 57004
SMILES:c1(O)c2c(cc(CCCC)c1)OC(C)=CC1C(C(C)(C)O)CCC3(OC3)C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -13.31
InChIKey:PRZQFCUGSDLVKF-UHFFFAOYSA-N
ID: 57005
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)-c2c1ccc(C(O)=O)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.419
CB1 binding score: -18.687
InChIKey:RUDAUXBQLBAKOW-UHFFFAOYSA-N
ID: 57006
SMILES:C(C(=O)CC)c1cc(OC)c2c(c1)OC(C)(C)c1ccc(C)cc1-2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.42
CB1 binding score: -15.457
InChIKey:DSNIWFCQTFSKSW-UHFFFAOYSA-N
ID: 57007
SMILES:C1(c2c(O)cc(CCCCC)cc2O)OC(=O)C(CCC=C(C)C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.854
InChIKey:ZGNBDHDIIXUCDX-UHFFFAOYSA-N
ID: 57008
SMILES:O=C(O)C1C(c2c(OC(=O)C)cc(CCCCC)cc2O)OC(C(C)(C)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.491
CB1 binding score: -17.595
InChIKey:VNSUIGYJKWDZNU-UHFFFAOYSA-N
ID: 57009
SMILES:c1(CCC(C(C=CCCC)=O)C)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -18.504
InChIKey:YHAJAYKVHYYBEQ-UHFFFAOYSA-N
ID: 57010
SMILES:C(=C(C)C)Cc1c(C(OC)=O)ccc2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 354.49
CB1 binding score: -14.257
InChIKey:INTPPJCKJXMSII-UHFFFAOYSA-N
ID: 57011
SMILES:C(CCC)c1ccc(=O)c2c(c1C)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.102
InChIKey:PDKNJTWFAHVGBH-UHFFFAOYSA-N
ID: 57012
SMILES:C1C2C(C)(C)Oc3c(c(O)c(C(=O)CCC)cc3O)C2C(=O)C(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -16.52
InChIKey:ZBHMWRRJDYYPLZ-UHFFFAOYSA-N
ID: 57013
SMILES:C1(C)=CCCC(=C)C2C(CC1)C(C)(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -16.18
InChIKey:BSWCFZVVTIAYIV-UHFFFAOYSA-N
ID: 57014
SMILES:C1(C(=C)C)CCC(=C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.279
InChIKey:KLYPAQJXUITNGB-UHFFFAOYSA-N
ID: 57015
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N