ID: 91939
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -17.439
InChIKey:XVOPFYNMQOZUKH-UHFFFAOYSA-N
ID: 91940
SMILES:C(C(C)C(C)(C(OC)=O)C1=CCC2C(C)(CCC3C2c2c(O)cc(C)cc2OC3(C)C)C1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -13.258
InChIKey:WMOFOIPLGUMYJD-UHFFFAOYSA-N
ID: 91941
SMILES:C1C(C)(C)C=CC(C)=CC1c1c(O)c(C(O)=O)c(CCCCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.527
InChIKey:PNQRXZDSNRHYFI-UHFFFAOYSA-N
ID: 91942
SMILES:c12c(C(=O)O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -18.51
InChIKey:ONTMVGJDPXZQKB-UHFFFAOYSA-N
ID: 91943
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(CCC=C(CCC=C(C)C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.944
InChIKey:PXPDKUHGJIMKBA-UHFFFAOYSA-N
ID: 91944
SMILES:C(C(=O)C(CC)C)CC(C)c1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -16.085
InChIKey:CCHBOSLGQVEMHE-UHFFFAOYSA-N
ID: 91945
SMILES:c1c(CCC)cc(O)c2c1OC1(C)C2CC(C(C)C)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.217
InChIKey:UMAPEYWRLXCCNN-UHFFFAOYSA-N
ID: 91946
SMILES:Oc1cc(CCCC)cc2c1C1C(C(C)(C)O2)OC(C)(C)C2CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -14.06
InChIKey:GISZDGXAASLECS-UHFFFAOYSA-N
ID: 91947
SMILES:O(C(=O)c1c2ccc(C)cc2c2c(c1OC)OC(C)(C)C1C2C=C(C)CC1)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.494
CB1 binding score: -15.103
InChIKey:CLAMOQHQHAETCC-UHFFFAOYSA-N
ID: 91948
SMILES:O1c2cc(CCCCC)cc(O)c2C2CC(C)=CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 91949
SMILES:C1(=C)C2(OO)C(O)C(C(=C)C)CCC2(C)C2CC1c1c(O)cc(CCCCC)cc1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -16.396
InChIKey:WUONHBFCDYOAQN-UHFFFAOYSA-N
ID: 91950
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C(C)(O)C)CCC(C)(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.848
InChIKey:GODMIXAMIQIMFE-UHFFFAOYSA-N
ID: 91951
SMILES:C(CCCCCCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -18.334
InChIKey:BKUUXHSLBMOYBZ-UHFFFAOYSA-N
ID: 91952
SMILES:Oc1ccc(C2C(C(C)=CC=CC(C)(C)O)(O)Oc3cc(CCCCC)cc(O)c32)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.564
CB1 binding score: -14.141
InChIKey:CLTRZZTXONWGDB-UHFFFAOYSA-N
ID: 91953
SMILES:C1(=O)OC(C(=CCCC(=CCc2cc(O)c(C)cc2OC)C)C)CC1C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -14.803
InChIKey:DLHQRRGLYVSUEA-UHFFFAOYSA-N
ID: 91954
SMILES:O1C2C3C(C)(Oc4c(c(O)cc(CCCCC)c4)C3O)CCC2C(O)(C)CCC2C(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -15.119
InChIKey:NTOTXNIJZISSEE-UHFFFAOYSA-N
ID: 91955
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3OC1C)OC(C)(C)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.892
InChIKey:LRFDSVNTIKFILT-UHFFFAOYSA-N
ID: 91956
SMILES:CC(C)C1c2c(C)c(C3C=C(C)CCC3C(C)=C)c(O)c(C(C)=O)c2OC(C)(C)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.609
CB1 binding score: -11.125
InChIKey:ZDKRMXVYCIFEOR-UHFFFAOYSA-N
ID: 91957
SMILES:CC1(C)C2C(c3c(O)cc(CCCCC)cc3O2)C=C(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.502
InChIKey:UAFBWNLSSMLMHH-UHFFFAOYSA-N
ID: 91958
SMILES:c1(O)c2c(cc(CCCCC)c1C(O)=O)OC(C)(C)C1C2CC(C)(CC=C(C)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -14.13
InChIKey:VLUYOPCAWATUKH-UHFFFAOYSA-N
ID: 91959
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N