ID: 109075
SMILES:C1CC(=C(C)C)C(CC(C)=C)Cc2c(O)ccc(O)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -15.545
InChIKey:UJZZRDAKBLRZNN-UHFFFAOYSA-N
ID: 109076
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCC)cc2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.748
InChIKey:ORIYPICUSOGUOA-UHFFFAOYSA-N
ID: 109077
SMILES:C1(C(=CCCC(=CC(c2c(O)cc(CCCCC)cc2O)=O)C)C)OC(=O)C(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.525
CB1 binding score: -15.519
InChIKey:FSCSYDLLPUSGNR-UHFFFAOYSA-N
ID: 109078
SMILES:Cc1c2c(cc(OC)c1)OC(C)(C)C1=CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.372
CB1 binding score: -12.888
InChIKey:GTEUAXWDGWKENR-UHFFFAOYSA-N
ID: 109079
SMILES:Oc1c(O)c(C2C=C(C)CCC2C(C)=C)c(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.388
InChIKey:XRSKTHYTMPGBSV-UHFFFAOYSA-N
ID: 109080
SMILES:c12c(c(CCCCC)cc(OC)c1)OC(C)(C)C1=C2C2C(C)(C(=O)CC(OC)=C2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -12.022
InChIKey:YUOVOPGPZGURRD-UHFFFAOYSA-N
ID: 109081
SMILES:C12C(C)(C)Oc3c(c(O)cc(C)c3C1)C(O)CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.702
InChIKey:IRUDWRNGLSXQHT-UHFFFAOYSA-N
ID: 109082
SMILES:C(CC)CCCCc1cc2c(c(O)c1)C1C(C(C)(CCC=C(C)C)O1)C(=O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -12.335
InChIKey:XCRTXMCJIWFQLF-UHFFFAOYSA-N
ID: 109083
SMILES:c1(CC(=O)OC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -17.493
InChIKey:OCKCAARWDANBIZ-UHFFFAOYSA-N
ID: 109084
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.332
InChIKey:XZWKSKOUODSSCT-UHFFFAOYSA-N
ID: 109085
SMILES:C(OCC(C)=CCc1c(C(=O)OC)c2c(o1)C1C=C(C)CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -17.156
InChIKey:XYURSYYQJLHBIX-UHFFFAOYSA-N
ID: 109086
SMILES:C(=C(C)C)CCC(c1c(O)cc(C2C(C(C)=C)CCC(C)=C2)c(O)c1)CC(=O)O
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 398.543
CB1 binding score: -14.223
InChIKey:NJGAPNNIQJDBPU-UHFFFAOYSA-N
ID: 109087
SMILES:Oc1c(CC=C(CCC=C(C)C)C)c(O)cc(C(C(C(C)CC)=O)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -18.604
InChIKey:MTPRSSDGZWGECT-UHFFFAOYSA-N
ID: 109088
SMILES:Oc1c(C)c(O)c(C(C(=O)OC)=CC)c2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -16.062
InChIKey:WPUMSODXKVWZMR-UHFFFAOYSA-N
ID: 109089
SMILES:c12c(O)cc(CCCCCC)cc1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 109090
SMILES:COc1c(CCCCC)cc2c(c1O)CC1C(C)(O2)CCC2C(C(=O)O)CCC21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -14.013
InChIKey:CTMRDNQMHVVZTJ-UHFFFAOYSA-N
ID: 109091
SMILES:C(C)C(c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(CO)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.063
InChIKey:LRCWNXJMZMRJNZ-UHFFFAOYSA-N
ID: 109092
SMILES:C12C(C=CC=C1C)c1c(cc(CCCCC)cc1OC)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.22
InChIKey:QZIKGLRTVHJWSO-UHFFFAOYSA-N
ID: 109093
SMILES:C(c1cc(OC)c(C2C=C(C)C(O)CC2C(C)=C)cc1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.605
InChIKey:YWGZLGBMTUXJJE-UHFFFAOYSA-N
ID: 109094
SMILES:C1C(C)(C)CC2C(=C1)C(=O)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.681
InChIKey:XNPZUYAXSIRBSH-UHFFFAOYSA-N
ID: 109095
SMILES:CCCCCc1cc(O)c2c(c1)OC(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