ID: 63064
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(C)(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.762
InChIKey:ICMJYQRNULRNTK-UHFFFAOYSA-N
ID: 63065
SMILES:OC1(C)C2(C(=O)O)Oc3c4c(cc(CCCCC)c3)OC(C)(C)C(C=C(C)C)c4c(C1=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.535
CB1 binding score: -13.862
InChIKey:CCPIYDJQVOZVKL-UHFFFAOYSA-N
ID: 63066
SMILES:C1=C(C)CCC=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -16.477
InChIKey:BSVBNBDUTPPCPS-UHFFFAOYSA-N
ID: 63067
SMILES:C12c3c(cc(CCCC)cc3O)OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 63068
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.196
InChIKey:HQWTZGLRGCSGTB-UHFFFAOYSA-N
ID: 63069
SMILES:CC(=CCCC1(C)Oc2cc(CCCCC)cc(OC)c2C=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.06
InChIKey:KSDSETBZUIJIFF-UHFFFAOYSA-N
ID: 63070
SMILES:CC(=CCCC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)c(O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.138
InChIKey:BZHWTNCHQIQETM-UHFFFAOYSA-N
ID: 63071
SMILES:c1(O)c2c(cc(CCC)c1)OC1(C)CC3C(C(C)(O)CC3C)C2C(CC(C)C)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -16.126
InChIKey:UJAQBDUTLAPYNK-UHFFFAOYSA-N
ID: 63072
SMILES:C(C)CCCc1cc(OC)c(C=O)c2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.448
InChIKey:MIDQZOKAWCTOGK-UHFFFAOYSA-N
ID: 63073
SMILES:CC1(C)C2C(c3c(cc(CCCCC)cc3O)O1)C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 63074
SMILES:Cc1cc2c(cc1)C(C)(C)Oc1cc(O)c(C(=S)C(C)C)c(O)c1CC=C(C)CCC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.633
CB1 binding score: -13.815
InChIKey:PHTRJKNFWPIPIC-UHFFFAOYSA-N
ID: 63075
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C1CCC(O)(C)C=C1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -13.342
InChIKey:JKXJTRYOLRWLJT-UHFFFAOYSA-N
ID: 63076
SMILES:CC(C)(C1C(c2c(O)cc(CCCCC)cc2O)CC2=CCCC(C)C12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -16.453
InChIKey:PVEDBCZPOHQXSI-UHFFFAOYSA-N
ID: 63077
SMILES:Oc1cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 63078
SMILES:CC1(CCO)CCC(Cc2cc(CCC(C)C)cc(O)c2O)C(C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.526
CB1 binding score: -15.804
InChIKey:RWNPHAQDXAVPQK-UHFFFAOYSA-N
ID: 63079
SMILES:c12c(c(C(=O)OC)cc(CCCCC)c1)OC(C)(C)C1CCC(C)=C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.605
InChIKey:NRZNQCVMVQSZIH-UHFFFAOYSA-N
ID: 63080
SMILES:CC(C1Oc2c(c(O)cc(CCCCC)c2)C2C1CC(C=O)=CC2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.557
InChIKey:UGCUNEYCKYBBOG-UHFFFAOYSA-N
ID: 63081
SMILES:C1(C)=CC(c2c(O)cc(CCCC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 63082
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(CCC(C(C)=C)O)O1)C(O)CC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -16.527
InChIKey:UYPQGTITXABIBD-UHFFFAOYSA-N
ID: 63083
SMILES:N(c1c(O)c2c(cc1O)OC(C)(C)C1CC=C(C)CC1C2)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 345.483
CB1 binding score: -11.379
InChIKey:SUZAULWGRYTTDR-UHFFFAOYSA-N
ID: 63084
SMILES:C(C(CCCC)C)Cc1cc2c(c(O)c1)C1CC(C)(O2)CCC1=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -14.819
InChIKey:ZADVTMBVMZGMNC-UHFFFAOYSA-N