ID: 112645
SMILES:C12CCC3(C)C(C3C1C(C)C)C(Oc1cc(CCCCCC)cc(O)c1)CC(C)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.642
CB1 binding score: -15.936
InChIKey:GYRZYYUKXDWXQT-UHFFFAOYSA-N
ID: 112646
SMILES:C(C)(C)=CC1c2c(cc(CCCCC)cc2OC)OC(C)(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.07
InChIKey:HQFKUGLSXVRACI-UHFFFAOYSA-N
ID: 112647
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 112648
SMILES:C1C(C(C)C)=CCC2(C)C1c1c(O)cc(C)cc1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -16.893
InChIKey:ZSJBSHYVMIYMFH-UHFFFAOYSA-N
ID: 112649
SMILES:C1(O)CC2(CC=C(CCC=C(C)C)C)C1(COC(c1ccccc1)=O)Oc1cc(CCCCC)cc(OC)c1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 546.748
CB1 binding score: -15.929
InChIKey:OQQXDVNNLFXHMO-UHFFFAOYSA-N
ID: 112650
SMILES:Oc1c(CC=C(C)CCC=C(C)[CH])c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.587
InChIKey:DIAPGWGVOSRGCD-UHFFFAOYSA-N
ID: 112651
SMILES:CC1(C)C(=O)C2c3c(cc(CCC)cc3O)OC3(C)C(CC=C(C)C)CC(C)(C2C(c2ccccc2)Cc2cc(O)cc(C)c21)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 620.874
CB1 binding score: -16.778
InChIKey:SXZJIZWQVORVKV-UHFFFAOYSA-N
ID: 112652
SMILES:c1(O)cc(CO)c2c(c1CC=C(CCC=C(C)C)C)COc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.619
CB1 binding score: -17.049
InChIKey:BKKKGPXPHSHUKT-UHFFFAOYSA-N
ID: 112653
SMILES:c1(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 112654
SMILES:CC(C)C1C2(C(C)C(O)C1)C(=O)c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.693
InChIKey:KGCMMGJHOWZQCU-UHFFFAOYSA-N
ID: 112655
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc1-2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -19.327
InChIKey:GGVVJZIANMUEJO-UHFFFAOYSA-N
ID: 112656
SMILES:CC1=CC23C(C)CC2c2c(cc(CCCCC)cc2OC)OC1C3=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -15.561
InChIKey:HYNXTNQRYASTPF-UHFFFAOYSA-N
ID: 112657
SMILES:C1=CC(C(C)C)C(c2cc(CCCCC)cc(O)c2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 314.469
CB1 binding score: -12.884
InChIKey:HZUHDNWRYYFBEX-UHFFFAOYSA-N
ID: 112658
SMILES:C1CC(=C)C(O)C2C1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.502
InChIKey:HDNJNVPZXVJOMB-UHFFFAOYSA-N
ID: 112659
SMILES:CC1CC=C(C(C)C)Cc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -14.372
InChIKey:POFUHYVJKYPTQW-UHFFFAOYSA-N
ID: 112660
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 112661
SMILES:c1(C)c(C(O)=O)c(C2C=C(C)CCC2C(C)=C)c(O)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -16.527
InChIKey:MPFSBGKXTNWZTI-UHFFFAOYSA-N
ID: 112662
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc1-2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 112663
SMILES:C(CCCc1cc(OC)c2c(c1)OC(C)(C)C1C2CC(=C)CC1)c1ccccc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.566
CB1 binding score: -13.831
InChIKey:OCKABKWQLMNSJP-UHFFFAOYSA-N
ID: 112664
SMILES:CC1(C)C2C(CC(C)CC2)c2c(O)c(C(=O)O)cc(CCC)c2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: Not available
InChIKey:ZBMDPGKZJYLZFG-UHFFFAOYSA-N
ID: 112665
SMILES:c1(O)c(C2C(C(C)=C)CCC(C)=C2)cc(O)c(CC=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -18.579
InChIKey:OYJXIBXDIWVTLP-UHFFFAOYSA-N