ID: 75034
SMILES:C1(C)(OC(=O)C)C2Cc3c(ccc(OC(=O)C)c3)OC(C)(C)C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -12.37
InChIKey:GBLQTXGTMIHQJC-UHFFFAOYSA-N
ID: 75035
SMILES:CCCCOc1c2c(cc(C)c1)OC(C)(C)C1OC(C)(CC1)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.438
InChIKey:GQITYNRARNBLOS-UHFFFAOYSA-N
ID: 75036
SMILES:C1(C)(C(O)=O)C2C3(c4c(cc(CCCC)cc4O)OC(C)(C)C(CC2)C3)C(=O)C(C(=C)C)(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.606
CB1 binding score: -15.601
InChIKey:DLSOGBUZMGKIOG-UHFFFAOYSA-N
ID: 75037
SMILES:c12c(O)cc(CCCCC)cc1OC(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
ID: 75038
SMILES:C(CCCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.427
InChIKey:UTXVBEHMQGNODO-UHFFFAOYSA-N
ID: 75039
SMILES:O=CC1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1[N+]#[C-]
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 353.462
CB1 binding score: -16.598
InChIKey:UKCJYENMMJTQAH-UHFFFAOYSA-N
ID: 75040
SMILES:CC1=CC2(O)C(C(C)(C)Oc3c(c(OC(C)=O)c(C(=O)O)cc3)C2)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.406
CB1 binding score: -14.043
InChIKey:AOQRDDCEHMAAAT-UHFFFAOYSA-N
ID: 75041
SMILES:C1CC(=C)C2C(C(CO)(C)Oc3c2c(O)ccc3)C(C=C(C)C)CC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -13.675
InChIKey:UPMANVDHOZOFMU-UHFFFAOYSA-N
ID: 75042
SMILES:CC1c2c(c(C(C)C)c(O)cc2)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -15.21
InChIKey:YCCREJMAMYAEHY-UHFFFAOYSA-N
ID: 75043
SMILES:C1CC(C)=CC2C1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 75044
SMILES:C(CC(C(=O)O)C)=C1C2C3(C(C)CC1C)c1c(cc(CCCCC)cc1O)OC3(C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -16.077
InChIKey:GIHHEBCVUQVTMK-UHFFFAOYSA-N
ID: 75045
SMILES:C(C1=CCC2(c3c(cc(CCCCC)cc3O)OC2(C)C)C1C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.477
InChIKey:XAXFMKVMEGGUJH-UHFFFAOYSA-N
ID: 75046
SMILES:C(C(OC)=O)(CCCC1=CC(c2c(O)cc(C)cc2O)OC1)(O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.384
CB1 binding score: -13.936
InChIKey:XWLKKEUYIXSKDP-UHFFFAOYSA-N
ID: 75047
SMILES:C(CCCCC)(c1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1)CC(=O)OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -13.264
InChIKey:MMQMNMHDRYSNOP-UHFFFAOYSA-N
ID: 75048
SMILES:c1c(C(C)C(CC)=O)c2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.118
InChIKey:NTORDACXICXFTJ-UHFFFAOYSA-N
ID: 75049
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 75050
SMILES:C(=C(C)C)CCC(C)=CCc1c(O)c(CCCC)c(O)c(C=O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 346.467
CB1 binding score: -15.442
InChIKey:AUSKJNTZIQWVPC-UHFFFAOYSA-N
ID: 75051
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCC)c3)C1(O)C(OC(C)=O)C(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.22
InChIKey:GLRHEDITDBWSCR-UHFFFAOYSA-N
ID: 75052
SMILES:CC(C1CCC2(C)OC3=C(C(=O)C4OC4C(C)(C)OOC3c3c(O)ccc4c3c(cc(C)c4O)O2)C1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.567
CB1 binding score: -15.305
InChIKey:LGBDTZFMCIWDQJ-UHFFFAOYSA-N
ID: 75053
SMILES:CC(CCC=C(C)C)=CCc1c(O)c(CC)cc(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.015
InChIKey:XODYWKMZGARMLO-UHFFFAOYSA-N
ID: 75054
SMILES:C(C1=CCC2C(c3c(cc(CCCCC)c(CC=C(C)C)c3)OC2)C1C(=C)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -14.435
InChIKey:CUVMECFNUMAUJX-UHFFFAOYSA-N