ID: 61615
SMILES:C(C(C)C)CC1C(O)C2(Oc3c(ccc(CCCCC)c3)C2O)CC=C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -18.866
InChIKey:BJHHYFBDXYEWDW-UHFFFAOYSA-N
ID: 61616
SMILES:c12c(c3c(c(O)c1)CC(O)C(C)(C)O3)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.604
InChIKey:DDSHIWNGWJQGRK-UHFFFAOYSA-N
ID: 61617
SMILES:c1c(CCC)cc(O)c2c1OC1(C)CCC(C(C)(C)O)OC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -16.009
InChIKey:FNQJDPOSLVYKHR-UHFFFAOYSA-N
ID: 61618
SMILES:C(C1(C)C(C)C(C)CCC1)C(O)C1(C)Oc2c(c(OC)cc(CCCCC)c2CCCCC)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.781
CB1 binding score: -15.151
InChIKey:BNJOWNCZTIULMO-UHFFFAOYSA-N
ID: 61619
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -19.67
InChIKey:QXOBJECFIJLBPW-UHFFFAOYSA-N
ID: 61620
SMILES:c1(CCCCCC)cc2c(c(OC)c1)C1C(CC=C(C)C)C(C)=CCC1C(=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -16.683
InChIKey:RTQTUHXOJAGRCR-UHFFFAOYSA-N
ID: 61621
SMILES:C(CC)Cc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 61622
SMILES:C1(C)CCC(C(C)C)CC1C1Oc2c(c(O)cc(CCCCC)c2)C(O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.592
CB1 binding score: -14.547
InChIKey:HWGCIFIDCKJAAU-UHFFFAOYSA-N
ID: 61623
SMILES:c1(CCCCC)cc(OC)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 61624
SMILES:c12cc(CCCCC)cc(O)c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.438
InChIKey:NKPBIUKTNLMNFS-UHFFFAOYSA-N
ID: 61625
SMILES:C1(OC)=CC2C(C(C)(C)Oc3c2c(O)ccc3CC=C(C)C)CC1(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.839
InChIKey:GKWOXQAEMBZNSX-UHFFFAOYSA-N
ID: 61626
SMILES:C(N)Cc1c2c(cc(O)c1)OC(C)(C)C1CC=C(C)C(O)C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 303.402
CB1 binding score: -13.69
InChIKey:WXTKRRIWPXCMRC-UHFFFAOYSA-N
ID: 61627
SMILES:C1C2C(C)(C)Oc3c(c(OCC=C(CCC=C(C)C)C)c(C(O)=O)c(O)c3)C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -13.711
InChIKey:FTDWLFPAZQRCKU-UHFFFAOYSA-N
ID: 61628
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1OC1C=C(C)CC2O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.947
InChIKey:PLBSJGXZVIUXQN-UHFFFAOYSA-N
ID: 61629
SMILES:O(C)c1c(O)cccc1C1=C(C(CC)C)CC(CC=C(C)C)C1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -13.662
InChIKey:CPJYTTDYBQDXPA-UHFFFAOYSA-N
ID: 61630
SMILES:C1C(c2c(O)cc(CCCCC)cc2OC)OC(C)(C)C1Br
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 371.315
CB1 binding score: -15.273
InChIKey:CYAOEKSEDPVROL-UHFFFAOYSA-N
ID: 61631
SMILES:c1(O)cc(CCCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 61632
SMILES:c1c(O)c(C(CC2(OC)c3c(cc(O)cc3C)CCC2(C)C)=O)ccc1CC(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -17.491
InChIKey:VDCXQAMKNJPLHA-UHFFFAOYSA-N
ID: 61633
SMILES:c1(O)cc(CCc2ccc(O)cc2)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.485
CB1 binding score: -14.656
InChIKey:CEBRDIBCYHLPDE-UHFFFAOYSA-N
ID: 61634
SMILES:CC12CC(O)CC(CO)(C)C1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -15.38
InChIKey:RFAOMJVCUYPIBA-UHFFFAOYSA-N
ID: 61635
SMILES:O=C1C(C)C2(Oc3c(c(O)cc(CCCCC)c3)C2C=C(C)C)C(O)=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -16.552
InChIKey:VUWFDOSTPKXNSO-UHFFFAOYSA-N