ID: 90385
SMILES:c1(O)c2c(cc(C(C)(C)CCCC(O)C)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.55
InChIKey:VESMVTRLZKEUCJ-UHFFFAOYSA-N
ID: 90386
SMILES:c12c(cc(OC)c(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.334
InChIKey:YHJDVXSICIKMSR-UHFFFAOYSA-N
ID: 90387
SMILES:CC(CCC(O)C(C)(C)O)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.618
CB1 binding score: -15.62
InChIKey:GGVNNXDAHBTPOF-UHFFFAOYSA-N
ID: 90388
SMILES:C(C=C(CC)C)C(=O)c1c(C)cc(O)c2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -14.674
InChIKey:YBWPVYAAQFLMHD-UHFFFAOYSA-N
ID: 90389
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1=C2C(=O)C(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.083
InChIKey:AYMRREFEEFYHLH-UHFFFAOYSA-N
ID: 90390
SMILES:OC(C)(C=CCC(=CCc1c(O)cc(O)cc1CCCCC)C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -14.713
InChIKey:YIJIJFRINGPLJJ-UHFFFAOYSA-N
ID: 90391
SMILES:O(O)C(CC(c1c(O)c(C(C(C)C)OC(CC)=O)c(O)c2c1OC(C)(C)C1CCC(C)=CC12)=O)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.62
CB1 binding score: -14.445
InChIKey:TWRHXWCHPSFAQV-UHFFFAOYSA-N
ID: 90392
SMILES:C(C=CS(=O)(=O)C)C(c1cc(O)c2c(c1C(O)=C1OCC(O)C1)OC(C)(C)C1CCC(C)=CC12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.601
CB1 binding score: -14.667
InChIKey:ZERVXNTXNNLXIK-UHFFFAOYSA-N
ID: 90393
SMILES:C1CC(C)=CCC23OC2(C1)C(C)(C)Oc1cc(O)cc(C)c13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -16.851
InChIKey:OHNYQVZHEWKIQJ-UHFFFAOYSA-N
ID: 90394
SMILES:C12=C(c3c(cc(CCCC)c(O)c3O)OC1(C)C)C(C)CCC2C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.219
InChIKey:FEFWFOPYWRHEPB-UHFFFAOYSA-N
ID: 90395
SMILES:O1c2cc(CCCCC)cc(OC)c2C2OC(C=C(C)C)C(O)C(C)C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.506
InChIKey:ZMTXAPHOXQNMJY-UHFFFAOYSA-N
ID: 90396
SMILES:C(=C)(C1CC(OC(C)=O)C2C(CC3C(=O)C2c2cc(CCCCC)ccc2O3)C1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -15.742
InChIKey:IQKBJZBMORDHPT-UHFFFAOYSA-N
ID: 90397
SMILES:Oc1c2c(c3c(c1-c1c(O)cc(CCCCC)cc1O)OC(C)(C)C1C3C(C)(O)CCC1=O)C1C(C(=C)C)CCC(C)(O)C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 620.783
CB1 binding score: -15.507
InChIKey:XVCSUYKFOGRMPO-UHFFFAOYSA-N
ID: 90398
SMILES:OC1(C(C)C)C2C(O)CC(C(O)=O)=CC2c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.279
InChIKey:ORFKJVQKPWAJAJ-UHFFFAOYSA-N
ID: 90399
SMILES:C1OC2(CC1OC(=O)C(C(C)C)OC(C)=O)C(C)=CC(c1c(C)cc(OC(C)=O)c(OC)c1C)CC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 530.658
CB1 binding score: -17.426
InChIKey:SSQBBJXMDBOCSK-UHFFFAOYSA-N
ID: 90400
SMILES:Cc1c(C(C)=O)c2c(cc1)C(C)(C)Oc1c-2cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -15.374
InChIKey:PPBVGWJRMHNMDJ-UHFFFAOYSA-N
ID: 90401
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 90402
SMILES:O=C(OCc1c(Sc2ccccc2)cc2c(c1OS(=O)(O)=O)OC(C)(C)C1CC=C(C)CC21)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.626
CB1 binding score: -15.889
InChIKey:FOYMUBRHZJAAGA-UHFFFAOYSA-N
ID: 90403
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1=C2C(=O)C(C)=CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.419
CB1 binding score: -16.934
InChIKey:RBOFETJAAOBFKI-UHFFFAOYSA-N
ID: 90404
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 90405
SMILES:COc1cc(CCCC)cc2c1OC(C)(C)c1ccc(CO)cc1-2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -15.393
InChIKey:AHXYYBCLHFBZNR-UHFFFAOYSA-N