ID: 95824
SMILES:C1C2C(Cc3c(O)c(C(=O)C)c(C)cc31)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: -16.39
InChIKey:LHAKEYJXCWCMIG-UHFFFAOYSA-N
ID: 95825
SMILES:Oc1c2c(cc(OC)c1CC(OC)C(CCC=C(C)C(=O)O)(C)O)OC(C)(C)C1CC=C(CCC=C(C)C)C(O)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 586.766
CB1 binding score: -14.801
InChIKey:RERGYODEDHEDKI-UHFFFAOYSA-N
ID: 95826
SMILES:Oc1cc(CCCCC)cc2c1-c1cc(C)ccc1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 95827
SMILES:c1(C(=O)C(CC)C)oc(C2(C)C(C(C)=C)CCC(C)=C2)c(O)c1CC(C(O)(C)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.574
CB1 binding score: -14.882
InChIKey:LYJNZIBTFGPHMU-UHFFFAOYSA-N
ID: 95828
SMILES:C12C(Cc3c(O)cc(CCCCC)cc3O1)C1C(C=C(C)C2=O)CC(O)(O)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -15.299
InChIKey:HMMQCCXMUBXIBN-UHFFFAOYSA-N
ID: 95829
SMILES:O=CC1=CC2C(C(C)(C)Oc3cc(CCC)cc(O)c32)C=CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.392
CB1 binding score: -13.63
InChIKey:KPGKLMIQZQPRPP-UHFFFAOYSA-N
ID: 95830
SMILES:C1(CCOC(=O)C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.288
InChIKey:CKKREYSHQVZOGE-UHFFFAOYSA-N
ID: 95831
SMILES:C1CC(C(C)=CCC=C(C)C)C(c2c(O)cc(CCCCC)cc2O)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -16.067
InChIKey:PFMNPHZGUGTMGI-UHFFFAOYSA-N
ID: 95832
SMILES:Oc1cc(O)c2c(c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -17.624
InChIKey:ZZWZWPVQXHMOQM-UHFFFAOYSA-N
ID: 95833
SMILES:C1C(=C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 95834
SMILES:CC(C)(O)C1CCC(O)(C)C2Oc3c(c(O)cc(CCCCC)c3)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.848
InChIKey:GODMIXAMIQIMFE-UHFFFAOYSA-N
ID: 95835
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(=C)C)CC(=O)C(C)=C1CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.491
CB1 binding score: -16.363
InChIKey:DYPJOWRGIPIPMG-UHFFFAOYSA-N
ID: 95836
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.053
InChIKey:HQRKNUDGMPVIMO-UHFFFAOYSA-N
ID: 95837
SMILES:C(C=Cc1c(O)c2c(cc1OC)OC(C)(C)C1CCC(C)=CC12)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.238
InChIKey:LGMBBVMDFHNCBQ-UHFFFAOYSA-N
ID: 95838
SMILES:c1(O)c(CCCC)cc(O)c2c1OC1(C)C3C(C(CCC=C(C)C)(C)OC2=O)CC1C=C3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -16.033
InChIKey:KJEMOFMUTSGCJF-UHFFFAOYSA-N
ID: 95839
SMILES:CC1(O)CCC(C(=C)C)C2c3c(O)cc(CCc4ccc(O)cc4)cc3OC(C)(C)C2C(=O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.602
CB1 binding score: -15.594
InChIKey:YXSJNAWATKMFJY-UHFFFAOYSA-N
ID: 95840
SMILES:C1(C(O)=O)=CCC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.319
InChIKey:FDBXLSVXSCZMKH-UHFFFAOYSA-N
ID: 95841
SMILES:COc1c2c(cc(CCCCC)c1)OC1(C(C)CCC(O)C(C)(C)O1)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -16.078
InChIKey:OQBDTPVGDKAENG-UHFFFAOYSA-N
ID: 95842
SMILES:CC12CCC(C(C)C)C1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -18.284
InChIKey:CRKIOILJSNLUMI-UHFFFAOYSA-N
ID: 95843
SMILES:C(Cc1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 95844
SMILES:COc1cc(CCCCC)cc2c1C(=O)C1(O2)C(O)=C(C(c2ccccc2)=O)C2C(C1)C(O)(C)CCC2C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 544.688
CB1 binding score: -15.656
InChIKey:CSKDGQFZIJYNRX-UHFFFAOYSA-N