ID: 60691
SMILES:C1C(OC(C(OC(C)=C(C)C)=O)CCCCC)CC(C)CC12C(=O)c1c(O)cc(OC(c3ccccc3)=O)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 606.756
CB1 binding score: -15.53
InChIKey:SICMILTUEDADDV-UHFFFAOYSA-N
ID: 60692
SMILES:C(CCCC)CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.687
InChIKey:RGXKCMQANRHRCO-UHFFFAOYSA-N
ID: 60693
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.189
InChIKey:AIOSXAOKGBOYPS-UHFFFAOYSA-N
ID: 60694
SMILES:C(=Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)C=CC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -17.874
InChIKey:YGIFBXXJTRRDKS-UHFFFAOYSA-N
ID: 60695
SMILES:c1(C2(C)C3(CO)CC3CC2)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -14.724
InChIKey:REYJWABNKLTQIX-UHFFFAOYSA-N
ID: 60696
SMILES:c1c(C(C)C)c(CC(=CCc2cc(OC)cc(CCCCC)c2)C)c(O)c(C2C=C(C)CCC2=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.794
CB1 binding score: -13.227
InChIKey:ZXKZZXPKNXHMKZ-UHFFFAOYSA-N
ID: 60697
SMILES:C(C(OC1C(OC(C)=O)C2=C(c3c(cc(CCC)cc3O)OC2(C)C)C1C)=O)CCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -14.254
InChIKey:FGBHBSWMJACHSR-UHFFFAOYSA-N
ID: 60698
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1C(C=C(C(O)=O)CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.994
InChIKey:WXGJTHWZSHNATO-UHFFFAOYSA-N
ID: 60699
SMILES:C(CC)CCc1c2c(cc(O)c1C)OC(C)(C=CC=C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.731
InChIKey:BMUASAMBADJWCY-UHFFFAOYSA-N
ID: 60700
SMILES:c1(CC=C)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -18.957
InChIKey:MTBKFELEBUQONK-UHFFFAOYSA-N
ID: 60701
SMILES:C=C(C)C1C2Oc3c(c(O)cc(C)c3)C3CC(C(C)(C)C(CC1)C2)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.527
InChIKey:MJCFTUNKMRGJAA-UHFFFAOYSA-N
ID: 60702
SMILES:C(CCCCc1cc2c(c(O)c1)C1CC(C)(C)C2CC(=O)C1C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.353
InChIKey:WARMWCXHKLYNHA-UHFFFAOYSA-N
ID: 60703
SMILES:c1(O)cc(C)c(CCC(O)(C)C=C2C34C(=C(C)CC3C(=C(C)C)CC2)OCO4)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -15.967
InChIKey:UDDSYMQLCMYVJC-UHFFFAOYSA-N
ID: 60704
SMILES:C1(O)C(CCC=C(C)C)(C)Oc2cc(CCCCC)cc(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 60705
SMILES:CC(=CCCC1(C)C2C3C(C(O)(C)CCC(O)C(C)=CC12)Oc1c(C(OC)=O)c(CCCCC)cc(O)c13)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 540.741
CB1 binding score: -14.55
InChIKey:YLIOPUZNLBICHX-UHFFFAOYSA-N
ID: 60706
SMILES:C1(c2c(O)cc(CCC)cc2O)C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 60707
SMILES:C(CC(C)C)c1c(O)c2c(c3c1OC(C)(C)C1C3C=C(C)CC1)OCC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -14.309
InChIKey:LEUVMOORMRIILU-UHFFFAOYSA-N
ID: 60708
SMILES:O1C(C=C(C)C)C(O)C2(C)Oc3c(C)cc(OC(=O)C)c(CCCCC)c3C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.553
InChIKey:NKROQXZCEKKSIP-UHFFFAOYSA-N
ID: 60709
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(=C)C)CCC2(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.123
InChIKey:XJJCEMPLQMTXHP-UHFFFAOYSA-N
ID: 60710
SMILES:C12C(C)(Oc3cc(CCCCC)c(O)cc31)CCC1(C)CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -13.175
InChIKey:KNWOEGDELGLZFY-UHFFFAOYSA-N
ID: 60711
SMILES:C1C(C)=C2C(CC=C(C)C)(CC1=O)c1c(O)cc(CCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -15.18
InChIKey:SPUGCXKSXHKYLF-UHFFFAOYSA-N